General
Preferred name
Methyl pyrrolidone
Synonyms
N-methyl-2-pyrrolidone ()
1-Methyl-2-pyrrolidone ()
NMP, N-Methylpyrrolidone ()
N-Methyl Pyrrolidinone ()
N-methyl-pyrrolidone ()
NSC-4594 ()
1-methylpyrrolidone ()
N-methylpyrrolidone ()
METHYLPYRROLIDONE ()
P&D ID
PD057995
CAS
51013-18-4
872-50-4
30207-69-3
26138-58-9
Tags
natural product
drug candidate
available
Drug Status
investigational
Max Phase
1.0
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
NMP is a common solvent and drug vehicle. More recently it has been identified as a candidate bromodomain ligand with antineoplastic and immunomodulatory activity . Mechanistically it appears to be a low-affinity, broad-spectrum acetyllysine mimetic, but with apparent comparable ligand efficiency to that of larger rationally developed compounds such as because of its very low molecular weight.
(GtoPdb)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
5
ChEMBL Drugs
Drug Repurposing Hub
DrugBank
Guide to Pharmacology
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
33
Molecular Weight
99.07
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
0
Ring Count
1
Aromatic Ring Count
0
cLogP
0.24
TPSA
20.31
Fraction CSP3
0.8
Chiral centers
0.0
Largest ring
5.0
QED
0.43
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
